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2,6-Bis(4-meth­oxy­phen­yl)-1,4-dithiine

The title mol­ecule, C(18)H(16)O(2)S(2), reveals crystallographic twofold rotation symmetry (with both S atoms lying on the axis) and one half-mol­ecule defines an asymmetric unit. The dithiine ring is in a boat conformation. The aromatic ring and the C=C bond are nearly coplanar, with small torsion...

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Detalles Bibliográficos
Autores principales: Zhao, Sha-Sha, Su, Qiong, Peng, Zhi-Hong, An, De-Lie
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998302/
https://www.ncbi.nlm.nih.gov/pubmed/24764863
http://dx.doi.org/10.1107/S1600536814000397
Descripción
Sumario:The title mol­ecule, C(18)H(16)O(2)S(2), reveals crystallographic twofold rotation symmetry (with both S atoms lying on the axis) and one half-mol­ecule defines an asymmetric unit. The dithiine ring is in a boat conformation. The aromatic ring and the C=C bond are nearly coplanar, with small torsion angles of −171.26 (19) and 8.5 (3)°. The two S—C bond lengths [1.7391 (19) and 1.7795 (18) Å] are shorter than single C—S bonds and longer than analogous C=S double bonds, which indicates a certain degree of conjugation between the lone pair on the S atom and π electrons of the C=C bond. The crystal packing only features van der Waals inter­actions.